SCHEMBL5118570

SCHEMBL5118570

Nc1nnc2ccc(OCCc3ccc(Cl)c(Cl)c3)cc2n1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.46
KCNH2 Q12809 1/20 0.45
GPR84 Q9NQS5 1/20 0.41
FFAR1 O14842 1/20 0.39
PIK3CG P48736 1/20 0.39
PNMT P11086 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
DRD2 P14416 1/20 0.38
HTR7 P34969 1/20 0.38
HTR6 P50406 1/20 0.38
PDE2A O00408 2/20 0.38
PDE10A Q9Y233 1/20 0.38
MAOB P27338 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5109857 0.78 GPR84 (0.45) CYP2D6KCNH2GPR84FFAR1PNMT
SCHEMBL5112701 0.77 APP (0.44) PIK3CGTAAR1
SCHEMBL5107008 0.72 NOS1 (0.45)
SCHEMBL5118892 0.72 HTR1D (0.42)
SCHEMBL5218850 0.68 DCPS (0.61) KCNH2
SCHEMBL10269565 0.68 KCNH2 (0.55) KCNH2GPR84FFAR1PNMTTAAR1
SCHEMBL5995026 0.67 MEN1 (0.56) PIK3CG
SCHEMBL12260619 0.67 GPR84 (0.51) CYP2D6KCNH2GPR84FFAR1PNMT
SCHEMBL5120425 0.67 GPR84 (0.46) CYP2D6KCNH2GPR84FFAR1PNMT
Hydrochloric Acid SCHEMBL28039636 0.65 KCNH2 (0.55) KCNH2GPR84FFAR1MAOB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080234276-A1 Heterocyclic Triazines as Hypoxic Selective Protein Kinase Inhibitors SENTINEL ONCOLOGY LIMITED (UK) 2008-09-25 US claimed
EP-1846392-A2 HETEROCYCLIC TRIAZINES AS HYPOXIC SELECTIVE PROTEIN KINASE INHIBITORS Sentinel Oncology Limited (GB) 2007-10-24 EP claimed
WO-2006131835-A2 HETEROCYCLIC TRIAZINES AS HYPOXIC SELECTIVE PROTEIN KINASE INHIBITORS SENTINEL ONCOLOGY LIMITED (GB) 2006-12-14 WO claimed
US-20080234276-A1 Heterocyclic Triazines as Hypoxic Selective Protein Kinase Inhibitors SENTINEL ONCOLOGY LIMITED (UK) 2008-09-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080234276-A1 Heterocyclic Triazines as Hypoxic Selective Protein Kinase Inhibitors HIF1AN, HIF1A, CDK2 CYP2D6 4352/4885KCNH2 3050/4885GPR84 1369/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.